1-(phenylmethyl)-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pyridin-2-one

Systemtic Name: 1-(phenylmethyl)-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pyridin-2-one Openeye Name: 5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-1-benzyl-pyridin-2-one CAS Name: 1-(phenylmethyl)-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-pyridinone IUPAC Name: 1-benzyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)pyridin-2-one Traditional Name: 5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-1-benzyl-2-pyridone Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)C2=CN(C(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=NNC1=S)C2=CN(C(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS/c1-2-10-21-16(18-19-17(21)23)14-8-9-15(22)20(12-14)11-13-6-4-3-5-7-13/h2-9,12H,1,10-11H2,(H,19,23)